1,2,3-Trichloro-5-(trifluoromethyl)benzene

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H2Cl3F3
Molecular Weight	249.445
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,2,3-Trichloro-5-(trifluoromethyl)benzene

Structure Search

SMILES

FC(F)(F)C1=CC(Cl)=C(Cl)C(Cl)=C1

InChI

InChIKey=FBKFIAIRSQOXJR-UHFFFAOYSA-N

InChI=1S/C7H2Cl3F3/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2H

HIDE SMILES / InChI

Molecular Formula	C7H2Cl3F3
Molecular Weight	249.445
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:11:53 GMT 2025` Edited by `admin` on `Mon Mar 31 23:11:53 GMT 2025`
Record UNII	88UV3JQC3W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,4,5-Trichloro-?,?,?-trifluorotoluene

Preferred Name

English

1,2,3-Trichloro-5-(trifluoromethyl)benzene

Systematic Name

English

3,4,5-Trichlorobenzotrifluoride

Common Name

English

Benzene, 1,2,3-trichloro-5-(trifluoromethyl)-

Systematic Name

English

Code System Code Type Description

CAS

50594-82-6

Created by admin on Mon Mar 31 23:11:53 GMT 2025 , Edited by admin on Mon Mar 31 23:11:53 GMT 2025

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PUBCHEM

2733399

Created by admin on Mon Mar 31 23:11:53 GMT 2025 , Edited by admin on Mon Mar 31 23:11:53 GMT 2025

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FDA UNII

88UV3JQC3W

Created by admin on Mon Mar 31 23:11:53 GMT 2025 , Edited by admin on Mon Mar 31 23:11:53 GMT 2025

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EPA CompTox

DTXSID00198633

Created by admin on Mon Mar 31 23:11:53 GMT 2025 , Edited by admin on Mon Mar 31 23:11:53 GMT 2025

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ECHA (EC/EINECS)

256-636-6

Created by admin on Mon Mar 31 23:11:53 GMT 2025 , Edited by admin on Mon Mar 31 23:11:53 GMT 2025

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